SMILES:
OC1(c2cnc3c(NCc4nnc5ccc(-c6cc(F)cc(F)c6)nn45)ccnc3c2)CCNCC1Molecular Processing
Molecular formula
C25H22F2N8O
Molecular weight
488.5
Exact mass
488.1885
XLogP
3.2
TPSA
113.15
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
36
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
129
Supplementary Information
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